Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e957c57dc37ebe7d85df340a0500ea61",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 106.040,
"b": 52.229,
"c": 106.381,
"alpha": 90.00,
"beta": 114.27,
"gamma": 90.00
},
"wavelengths": [1.07000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [100.000,1.920],
"number_observations_unique": 50708,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "I/SigI",
"value": 17.500
},
{
"type": "Completeness",
"value": 93.500
},
{
"type": "Redundancy",
"value": 2.900
}
]
},
"refln_shells": [
{
"resolution_limits": [1.950,1.920],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.417
},
{
"type": "Completeness",
"value": 95.900
},
{
"type": "Redundancy",
"value": 2.900
}
]
},
{
"resolution_limits": [1.990,1.950],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.344
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "Redundancy",
"value": 2.900
}
]
},
{
"resolution_limits": [2.030,1.990],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.287
},
{
"type": "Completeness",
"value": 95.700
},
{
"type": "Redundancy",
"value": 3.000
}
]
},
{
"resolution_limits": [2.070,2.030],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.213
},
{
"type": "Completeness",
"value": 95.100
},
{
"type": "Redundancy",
"value": 2.900
}
]
},
{
"resolution_limits": [2.110,2.070],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.186
},
{
"type": "Completeness",
"value": 95.300
},
{
"type": "Redundancy",
"value": 2.900
}
]
},
{
"resolution_limits": [2.160,2.110],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.160
},
{
"type": "Completeness",
"value": 95.000
},
{
"type": "Redundancy",
"value": 3.000
}
]
},
{
"resolution_limits": [2.220,2.160],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.131
},
{
"type": "Completeness",
"value": 95.100
},
{
"type": "Redundancy",
"value": 3.000
}
]
},
{
"resolution_limits": [2.280,2.220],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.127
},
{
"type": "Completeness",
"value": 96.100
},
{
"type": "Redundancy",
"value": 2.900
}
]
},
{
"resolution_limits": [2.340,2.280],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.105
},
{
"type": "Completeness",
"value": 94.200
},
{
"type": "Redundancy",
"value": 3.000
}
]
},
{
"resolution_limits": [2.420,2.340],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "Completeness",
"value": 95.500
},
{
"type": "Redundancy",
"value": 3.000
}
]
},
{
"resolution_limits": [2.510,2.420],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "Completeness",
"value": 95.400
},
{
"type": "Redundancy",
"value": 2.900
}
]
},
{
"resolution_limits": [2.610,2.510],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.078
},
{
"type": "Completeness",
"value": 95.600
},
{
"type": "Redundancy",
"value": 2.900
}
]
},
{
"resolution_limits": [2.720,2.610],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "Completeness",
"value": 93.700
},
{
"type": "Redundancy",
"value": 2.800
}
]
},
{
"resolution_limits": [2.870,2.720],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.062
},
{
"type": "Completeness",
"value": 95.800
},
{
"type": "Redundancy",
"value": 2.800
}
]
},
{
"resolution_limits": [3.050,2.870],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "Completeness",
"value": 94.600
},
{
"type": "Redundancy",
"value": 2.800
}
]
},
{
"resolution_limits": [3.280,3.050],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "Completeness",
"value": 92.000
},
{
"type": "Redundancy",
"value": 2.700
}
]
},
{
"resolution_limits": [3.610,3.280],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "Completeness",
"value": 91.500
},
{
"type": "Redundancy",
"value": 2.700
}
]
},
{
"resolution_limits": [4.140,3.610],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "Completeness",
"value": 89.300
},
{
"type": "Redundancy",
"value": 2.600
}
]
},
{
"resolution_limits": [5.210,4.140],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "Completeness",
"value": 88.100
},
{
"type": "Redundancy",
"value": 2.700
}
]
},
{
"resolution_limits": [100.000,5.210],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "Completeness",
"value": 82.500
},
{
"type": "Redundancy",
"value": 2.700
}
]
}
]
}