Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fe3ac462329cc49a91cd4d810b989f68",
"space_group_name": "H 3",
"unit_cell": {
"a": 170.236,
"b": 170.236,
"c": 61.820,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [25.00,2.200],
"number_observations_unique": 32945,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "I/SigI",
"value": 7.900
},
{
"type": "Completeness",
"value": 97.100
},
{
"type": "Redundancy",
"value": 5.590
}
]
},
"refln_shells": [
{
"resolution_limits": [2.28,2.20],
"number_observations": 18908,
"number_observations_unique": 3289,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.359
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Completeness",
"value": 96.80
},
{
"type": "Redundancy",
"value": 5.67
}
]
},
{
"resolution_limits": [2.37,2.28],
"number_observations": 19114,
"number_observations_unique": 3313,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.313
},
{
"type": "I/SigI",
"value": 2.4
},
{
"type": "Completeness",
"value": 97.00
},
{
"type": "Redundancy",
"value": 5.66
}
]
},
{
"resolution_limits": [2.48,2.37],
"number_observations": 19037,
"number_observations_unique": 3296,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.257
},
{
"type": "I/SigI",
"value": 2.8
},
{
"type": "Completeness",
"value": 97.40
},
{
"type": "Redundancy",
"value": 5.62
}
]
},
{
"resolution_limits": [2.61,2.48],
"number_observations": 19139,
"number_observations_unique": 3305,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.223
},
{
"type": "I/SigI",
"value": 3.2
},
{
"type": "Completeness",
"value": 98.00
},
{
"type": "Redundancy",
"value": 5.64
}
]
},
{
"resolution_limits": [2.77,2.61],
"number_observations": 19322,
"number_observations_unique": 3325,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.179
},
{
"type": "I/SigI",
"value": 4.1
},
{
"type": "Completeness",
"value": 98.10
},
{
"type": "Redundancy",
"value": 5.64
}
]
},
{
"resolution_limits": [2.98,2.77],
"number_observations": 19400,
"number_observations_unique": 3306,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.135
},
{
"type": "I/SigI",
"value": 5.3
},
{
"type": "Completeness",
"value": 97.60
},
{
"type": "Redundancy",
"value": 5.65
}
]
},
{
"resolution_limits": [3.28,2.98],
"number_observations": 19566,
"number_observations_unique": 3316,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.093
},
{
"type": "I/SigI",
"value": 7.6
},
{
"type": "Completeness",
"value": 97.50
},
{
"type": "Redundancy",
"value": 5.62
}
]
},
{
"resolution_limits": [3.76,3.28],
"number_observations": 19633,
"number_observations_unique": 3289,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 12.0
},
{
"type": "Completeness",
"value": 97.10
},
{
"type": "Redundancy",
"value": 5.56
}
]
},
{
"resolution_limits": [4.73,3.76],
"number_observations": 19789,
"number_observations_unique": 3302,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 18.4
},
{
"type": "Completeness",
"value": 97.30
},
{
"type": "Redundancy",
"value": 5.48
}
]
},
{
"resolution_limits": [24.66,4.73],
"number_observations": 19897,
"number_observations_unique": 3204,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.03
},
{
"type": "I/SigI",
"value": 22.4
},
{
"type": "Completeness",
"value": 94.70
},
{
"type": "Redundancy",
"value": 5.33
}
]
}
]
}