Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8ab38612a9439c02593ffd6bc1146fec",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 95.034,
"b": 95.034,
"c": 63.295,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.540,2.30],
"number_observations_unique": 14896,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.220
},
{
"type": "I/SigI",
"value": 10.200
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 7.400
}
]
},
"refln_shells": [
{
"resolution_limits": [2.36,2.30],
"number_observations": 8211,
"number_observations_unique": 1103,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "Completeness",
"value": 99.00
},
{
"type": "Redundancy",
"value": 7.40
}
]
},
{
"resolution_limits": [2.42,2.36],
"number_observations": 7917,
"number_observations_unique": 1061,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 99.70
},
{
"type": "Redundancy",
"value": 7.50
}
]
},
{
"resolution_limits": [2.49,2.42],
"number_observations": 7638,
"number_observations_unique": 1022,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 99.40
},
{
"type": "Redundancy",
"value": 7.50
}
]
},
{
"resolution_limits": [2.57,2.49],
"number_observations": 7293,
"number_observations_unique": 979,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 2.7
},
{
"type": "Completeness",
"value": 99.40
},
{
"type": "Redundancy",
"value": 7.40
}
]
},
{
"resolution_limits": [2.66,2.57],
"number_observations": 7281,
"number_observations_unique": 984,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 3.3
},
{
"type": "Completeness",
"value": 99.40
},
{
"type": "Redundancy",
"value": 7.40
}
]
},
{
"resolution_limits": [2.75,2.66],
"number_observations": 6834,
"number_observations_unique": 924,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 3.8
},
{
"type": "Completeness",
"value": 99.50
},
{
"type": "Redundancy",
"value": 7.40
}
]
},
{
"resolution_limits": [2.85,2.75],
"number_observations": 6886,
"number_observations_unique": 922,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 4.2
},
{
"type": "Completeness",
"value": 99.90
},
{
"type": "Redundancy",
"value": 7.50
}
]
},
{
"resolution_limits": [2.97,2.85],
"number_observations": 6442,
"number_observations_unique": 868,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 5.4
},
{
"type": "Completeness",
"value": 99.60
},
{
"type": "Redundancy",
"value": 7.40
}
]
},
{
"resolution_limits": [3.10,2.97],
"number_observations": 6288,
"number_observations_unique": 843,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 7.1
},
{
"type": "Completeness",
"value": 99.50
},
{
"type": "Redundancy",
"value": 7.50
}
]
},
{
"resolution_limits": [3.25,3.10],
"number_observations": 5881,
"number_observations_unique": 796,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 8.8
},
{
"type": "Completeness",
"value": 99.70
},
{
"type": "Redundancy",
"value": 7.40
}
]
},
{
"resolution_limits": [3.43,3.25],
"number_observations": 5776,
"number_observations_unique": 783,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 11.6
},
{
"type": "Completeness",
"value": 99.80
},
{
"type": "Redundancy",
"value": 7.40
}
]
},
{
"resolution_limits": [3.64,3.43],
"number_observations": 5313,
"number_observations_unique": 722,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 15.5
},
{
"type": "Completeness",
"value": 99.80
},
{
"type": "Redundancy",
"value": 7.40
}
]
},
{
"resolution_limits": [3.89,3.64],
"number_observations": 5014,
"number_observations_unique": 684,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 18.4
},
{
"type": "Completeness",
"value": 99.80
},
{
"type": "Redundancy",
"value": 7.30
}
]
},
{
"resolution_limits": [4.20,3.89],
"number_observations": 4775,
"number_observations_unique": 657,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 21.4
},
{
"type": "Completeness",
"value": 99.80
},
{
"type": "Redundancy",
"value": 7.30
}
]
},
{
"resolution_limits": [4.60,4.20],
"number_observations": 4239,
"number_observations_unique": 583,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 25.8
},
{
"type": "Completeness",
"value": 99.80
},
{
"type": "Redundancy",
"value": 7.30
}
]
},
{
"resolution_limits": [5.14,4.60],
"number_observations": 3994,
"number_observations_unique": 551,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 27.3
},
{
"type": "Completeness",
"value": 99.90
},
{
"type": "Redundancy",
"value": 7.20
}
]
},
{
"resolution_limits": [5.94,5.14],
"number_observations": 3459,
"number_observations_unique": 485,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 22.2
},
{
"type": "Completeness",
"value": 99.90
},
{
"type": "Redundancy",
"value": 7.10
}
]
},
{
"resolution_limits": [7.27,5.94],
"number_observations": 2902,
"number_observations_unique": 410,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 21.8
},
{
"type": "Completeness",
"value": 99.90
},
{
"type": "Redundancy",
"value": 7.10
}
]
},
{
"resolution_limits": [10.29,7.27],
"number_observations": 2275,
"number_observations_unique": 334,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 31.0
},
{
"type": "Completeness",
"value": 99.90
},
{
"type": "Redundancy",
"value": 6.80
}
]
},
{
"resolution_limits": [29.54,10.29],
"number_observations": 1160,
"number_observations_unique": 185,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 37.5
},
{
"type": "Completeness",
"value": 95.80
},
{
"type": "Redundancy",
"value": 6.30
}
]
}
]
}