Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5d1f324d57d278096742bb780475451a",
"space_group_name": "I 2 3",
"unit_cell": {
"a": 120.88,
"b": 120.88,
"c": 120.88,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91837,0.97982],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [28.490,2.00],
"number_observations_unique": 19903,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "I/SigI",
"value": 11.950
},
{
"type": "Completeness",
"value": 99.100
}
]
},
"refln_shells": [
{
"resolution_limits": [2.07,2.00],
"number_observations": 10258,
"number_observations_unique": 3591,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.866
},
{
"type": "I/SigI",
"value": 1.4
},
{
"type": "Completeness",
"value": 96.20
}
]
},
{
"resolution_limits": [2.15,2.07],
"number_observations": 10691,
"number_observations_unique": 3738,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.628
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "Completeness",
"value": 99.60
}
]
},
{
"resolution_limits": [2.25,2.15],
"number_observations": 11265,
"number_observations_unique": 3942,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.449
},
{
"type": "I/SigI",
"value": 2.6
},
{
"type": "Completeness",
"value": 99.50
}
]
},
{
"resolution_limits": [2.37,2.25],
"number_observations": 11227,
"number_observations_unique": 3915,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.333
},
{
"type": "I/SigI",
"value": 3.4
},
{
"type": "Completeness",
"value": 99.40
}
]
},
{
"resolution_limits": [2.52,2.37],
"number_observations": 11105,
"number_observations_unique": 3850,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.242
},
{
"type": "I/SigI",
"value": 4.6
},
{
"type": "Completeness",
"value": 99.60
}
]
},
{
"resolution_limits": [2.71,2.52],
"number_observations": 10906,
"number_observations_unique": 3780,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.179
},
{
"type": "I/SigI",
"value": 6.2
},
{
"type": "Completeness",
"value": 99.60
}
]
},
{
"resolution_limits": [2.99,2.71],
"number_observations": 11370,
"number_observations_unique": 3920,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.120
},
{
"type": "I/SigI",
"value": 9.3
},
{
"type": "Completeness",
"value": 99.50
}
]
},
{
"resolution_limits": [3.42,2.99],
"number_observations": 11105,
"number_observations_unique": 3840,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 16.8
},
{
"type": "Completeness",
"value": 99.70
}
]
},
{
"resolution_limits": [4.30,3.42],
"number_observations": 11016,
"number_observations_unique": 3789,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 31.8
},
{
"type": "Completeness",
"value": 99.30
}
]
},
{
"resolution_limits": [28.490,4.30],
"number_observations": 11214,
"number_observations_unique": 3845,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 41.2
},
{
"type": "Completeness",
"value": 98.70
}
]
}
]
}